NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 R 4.2244 8.2431 119.7172 55.9857 31.9425 175.9934 1 G 3.9088 8.3201 102.8181 44.7888 0.0000 173.4035 2 I 3.2395 9.0323 122.1274 64.0430 38.4729 177.2716 3 V 3.6399 7.5586 112.6632 64.1307 31.3135 177.8593 4 E 3.8216 8.0690 117.5187 58.4333 29.6866 177.6116 5 Q 4.2801 8.1751 118.7544 57.6358 29.3595 175.4203 6 C 4.8609 8.0237 114.7143 57.6678 43.0155 174.5686 7 C 4.2712 7.9941 117.8168 61.6812 31.6918 174.4025 8 T 4.2957 8.8079 114.1773 64.6697 68.7435 174.5038 9 S 4.5616 7.4933 116.3591 57.3222 66.0239 172.1860 10 I 4.6192 8.3928 121.7796 60.3575 39.9337 173.5801 11 C 5.5836 8.5933 118.5738 52.5671 39.6908 174.1499 12 S 4.4690 8.3373 117.0637 56.9304 64.2177 173.7931 13 L 3.9851 8.6723 119.6299 58.9572 39.8930 177.4410 14 Y 4.2398 7.7764 118.6180 57.4501 39.3722 175.4074 15 Q 4.7395 8.2276 115.2926 54.9526 31.9691 176.9983 16 L 4.6211 7.8231 117.1746 56.0146 43.2084 178.1989 17 E 4.0327 7.9882 117.7385 58.3838 29.3616 178.5388 18 N 4.2987 7.8455 115.3240 55.2008 38.6688 175.1021 19 Y 4.6772 7.4660 113.8200 57.6287 38.7869 175.7723 20 C 4.4077 7.4484 117.1153 59.1884 28.9436 173.5283 21 N 4.5171 8.6320 118.7234 53.7954 38.0779 175.1264 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 0 R 8.24 4.22 0.00 1.95 2.05 0.00 3.16 0.00 0.00 3.39 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.67 0.00 1 G 8.32 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 I 9.03 3.24 0.87 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.66 0.68 0.00 0.00 3 V 7.56 3.64 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.90 0.00 0.00 4 E 8.07 3.82 0.00 1.96 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 5 Q 8.18 4.28 0.00 2.40 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.51 0.00 0.00 0.00 0.00 0.00 2.43 2.46 0.00 6 C 8.02 4.86 0.00 3.15 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 C 7.99 4.27 0.00 2.90 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 T 8.81 4.30 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 9 S 7.49 4.56 0.00 4.10 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 I 8.39 4.62 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.62 0.93 0.00 0.00 11 C 8.59 5.58 0.00 3.10 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.34 4.47 0.00 3.92 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 L 8.67 3.99 0.00 1.93 1.95 1.05 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.78 4.24 0.00 2.99 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 Q 8.23 4.74 0.00 2.26 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.01 6.38 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 16 L 7.82 4.62 0.00 1.73 1.74 0.94 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 17 E 7.99 4.03 0.00 1.42 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.01 0.00 18 N 7.85 4.30 0.00 1.98 2.29 0.00 0.00 6.80 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 Y 7.47 4.68 0.00 2.96 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 C 7.45 4.41 0.00 3.00 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 N 8.63 4.52 0.00 2.71 2.74 0.00 0.00 6.81 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00